2-{[2-(Dibutylamino)ethyl]thio}-2',5'-dichloroacetanildie, monohydrochloride

SpectraBase Compound ID	EgiRp45cafz
InChI	InChI=1S/C18H28Cl2N2OS.ClH/c1-3-5-9-22(10-6-4-2)11-12-24-14-18(23)21-17-13-15(19)7-8-16(17)20;/h7-8,13H,3-6,9-12,14H2,1-2H3,(H,21,23);1H
InChIKey	PJLDGKHGAHFJPA-UHFFFAOYSA-N Google Search
Mol Weight	427.86 g/mol
Molecular Formula	C18H29Cl3N2OS
Exact Mass	426.106618 g/mol

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SpectraBase Spectrum ID	HDMAxXgHXkU
Name	N-butyl-N-(2-{[2-(2,5-dichloroanilino)-2-oxoethyl]sulfanyl}ethyl)-1-butanaminium chloride
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C18H28Cl2N2OS.ClH/c1-3-5-9-22(10-6-4-2)11-12-24-14-18(23)21-17-13-15(19)7-8-16(17)20;/h7-8,13H,3-6,9-12,14H2,1-2H3,(H,21,23);1H
InChIKey	PJLDGKHGAHFJPA-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_15474
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 987/00002075; Labnumber: 987/00002075218824; VK_ID: VK-015479
Temperature	308 °C